==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-APR-00 1C83 . COMPND 2 MOLECULE: PROTEIN (PROTEIN-TYROSINE PHOSPHATASE 1B); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.S.ANDERSEN,L.F.IVERSEN,S.BRANNER,H.B.RASMUSSEN,N.P.MOLLER . 297 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13451.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 214 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 39 13.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 31 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 2 0 1 2 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 1 0 0 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A E > 0 0 75 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 137.4 69.3 16.5 20.8 2 3 A M H > + 0 0 11 238,-0.2 4,-1.8 241,-0.2 272,-0.1 0.628 360.0 62.2 -44.6 -26.1 66.5 16.5 18.0 3 4 A E H > S+ 0 0 94 2,-0.2 4,-2.2 3,-0.2 -1,-0.2 0.839 101.2 46.3 -83.5 -34.8 68.2 19.8 17.1 4 5 A K H > S+ 0 0 152 -3,-0.3 4,-2.7 2,-0.2 -2,-0.2 0.882 115.1 48.8 -65.6 -45.6 71.6 18.1 16.2 5 6 A E H X S+ 0 0 46 -4,-1.9 4,-2.9 2,-0.2 5,-0.3 0.900 109.3 52.7 -58.6 -43.3 69.6 15.6 14.3 6 7 A F H X S+ 0 0 17 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.959 111.4 45.7 -56.4 -49.2 67.7 18.4 12.6 7 8 A E H X S+ 0 0 133 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.890 112.9 50.3 -61.8 -45.8 71.0 20.0 11.6 8 9 A Q H X S+ 0 0 118 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.970 112.9 45.4 -48.9 -61.4 72.4 16.7 10.4 9 10 A I H <>S+ 0 0 8 -4,-2.9 5,-2.2 2,-0.2 6,-0.4 0.834 114.0 50.5 -55.3 -38.5 69.3 15.8 8.2 10 11 A D H ><5S+ 0 0 65 -4,-2.4 3,-1.3 -5,-0.3 -1,-0.2 0.969 112.0 46.1 -65.2 -54.6 69.3 19.4 6.8 11 12 A K H 3<5S+ 0 0 155 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.933 116.8 43.5 -51.6 -50.2 73.0 19.3 5.9 12 13 A S T 3<5S- 0 0 76 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.516 105.9-132.5 -77.3 8.0 72.7 15.8 4.3 13 14 A G T < 5 + 0 0 62 -3,-1.3 3,-0.3 -4,-0.3 -3,-0.2 0.843 60.5 139.7 43.7 44.7 69.4 17.0 2.6 14 15 A S >< + 0 0 32 -5,-2.2 4,-2.6 1,-0.2 5,-0.2 0.107 15.6 115.2-111.1 28.9 67.8 13.7 3.8 15 16 A W H > S+ 0 0 23 -6,-0.4 4,-2.5 1,-0.2 5,-0.2 0.884 79.6 53.9 -61.9 -41.5 64.2 14.7 5.0 16 17 A A H > S+ 0 0 67 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.895 111.2 44.6 -61.0 -42.0 62.6 12.6 2.3 17 18 A A H > S+ 0 0 51 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.894 112.6 50.6 -68.0 -38.6 64.6 9.5 3.2 18 19 A I H X S+ 0 0 27 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.940 112.0 48.4 -60.5 -46.1 63.9 9.9 6.9 19 20 A Y H X S+ 0 0 6 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.924 111.2 49.1 -60.7 -49.6 60.2 10.4 6.2 20 21 A Q H X S+ 0 0 86 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.857 104.6 59.8 -56.3 -38.9 60.1 7.2 4.0 21 22 A D H X S+ 0 0 86 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.949 107.9 45.9 -55.0 -43.1 61.9 5.3 6.7 22 23 A I H X S+ 0 0 1 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.936 110.6 50.9 -62.3 -51.4 59.0 6.2 8.9 23 24 A R H < S+ 0 0 116 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.913 112.6 48.2 -49.4 -46.8 56.3 5.3 6.4 24 25 A H H < S+ 0 0 167 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.870 115.1 43.8 -61.4 -40.1 58.1 1.9 5.8 25 26 A E H < S+ 0 0 119 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.606 91.2 118.6 -76.5 -24.3 58.3 1.2 9.6 26 27 A A S < S- 0 0 25 -4,-1.8 224,-0.1 -5,-0.2 228,-0.1 -0.219 72.2 -96.5 -56.0 143.5 54.7 2.4 10.2 27 28 A S - 0 0 36 223,-0.3 2,-0.5 229,-0.1 -1,-0.1 -0.151 27.9-156.5 -51.8 142.6 52.0 -0.1 11.7 28 29 A D + 0 0 154 229,-0.1 -1,-0.1 23,-0.0 226,-0.1 -0.924 23.4 163.1-130.6 98.7 49.7 -1.9 9.4 29 30 A F - 0 0 82 -2,-0.5 228,-0.1 1,-0.0 226,-0.0 -0.862 42.2 -89.9-110.6 160.0 46.5 -3.0 11.1 30 31 A P - 0 0 59 0, 0.0 22,-3.1 0, 0.0 23,-0.4 -0.346 24.5-170.4 -63.0 142.4 43.1 -4.2 9.6 31 32 A C > + 0 0 18 20,-0.3 4,-1.7 21,-0.1 5,-0.1 -0.492 31.4 147.0-122.9 52.4 40.4 -1.7 8.8 32 33 A R T 4 S+ 0 0 184 2,-0.2 4,-0.3 1,-0.2 -1,-0.1 0.877 70.8 49.3 -54.6 -46.7 37.7 -4.4 8.0 33 34 A V T >4 S+ 0 0 29 1,-0.2 3,-1.8 2,-0.2 6,-0.2 0.955 108.6 53.3 -64.9 -40.0 34.8 -2.3 9.3 34 35 A A T 34 S+ 0 0 1 16,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.876 111.1 48.3 -53.1 -43.1 35.9 0.8 7.4 35 36 A K T 3< S+ 0 0 120 -4,-1.7 -1,-0.3 3,-0.1 -2,-0.2 0.335 79.8 121.6 -83.8 4.0 35.9 -1.3 4.2 36 37 A L S X S- 0 0 74 -3,-1.8 3,-2.1 -4,-0.3 4,-0.3 -0.500 74.1-118.8 -63.0 142.7 32.5 -2.9 4.7 37 38 A P G > S+ 0 0 118 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.838 112.4 59.2 -45.6 -42.4 30.3 -2.1 1.6 38 39 A K G 3 S+ 0 0 125 1,-0.2 3,-0.3 2,-0.1 -4,-0.1 0.717 103.1 51.7 -61.1 -21.9 27.8 -0.4 3.9 39 40 A N G X S+ 0 0 0 -3,-2.1 3,-1.7 -6,-0.2 4,-0.4 0.284 76.3 104.7 -99.5 9.2 30.4 2.2 5.1 40 41 A K G X S+ 0 0 175 -3,-1.4 3,-1.5 -4,-0.3 -1,-0.2 0.942 81.8 47.6 -56.4 -49.5 31.5 3.2 1.6 41 42 A N G 3 S+ 0 0 103 -4,-0.3 -1,-0.3 -3,-0.3 48,-0.2 0.467 104.3 63.4 -74.9 4.7 29.6 6.5 1.8 42 43 A R G < S+ 0 0 23 -3,-1.7 25,-0.5 -8,-0.2 2,-0.4 0.387 89.2 77.1-103.0 -0.6 31.1 7.2 5.3 43 44 A N < - 0 0 26 -3,-1.5 3,-0.1 -4,-0.4 6,-0.1 -0.943 60.5-161.9-113.3 133.3 34.7 7.4 4.1 44 45 A R S S+ 0 0 51 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.904 79.9 31.2 -76.1 -46.2 36.0 10.5 2.3 45 46 A Y S > S- 0 0 66 3,-0.4 3,-1.4 171,-0.1 -1,-0.2 -0.961 70.4-139.9-119.8 131.3 39.1 9.0 0.8 46 47 A R T 3 S+ 0 0 191 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.811 103.6 48.7 -49.6 -36.3 39.6 5.4 -0.3 47 48 A D T 3 S+ 0 0 109 1,-0.1 2,-0.5 2,-0.0 -1,-0.2 0.294 99.1 75.2-101.0 10.3 43.1 5.2 1.1 48 49 A V < + 0 0 13 -3,-1.4 -3,-0.4 2,-0.0 -4,-0.2 -0.897 57.2 145.1-127.9 111.2 42.4 6.6 4.5 49 50 A S - 0 0 3 -2,-0.5 208,-0.6 -6,-0.1 2,-0.2 -0.956 47.5-107.9-135.5 152.0 40.6 4.4 7.1 50 51 A P - 0 0 0 0, 0.0 -16,-0.4 0, 0.0 2,-0.1 -0.580 38.8-113.0 -75.1 141.0 40.6 3.9 10.9 51 52 A F > - 0 0 3 204,-0.4 4,-0.8 -2,-0.2 3,-0.4 -0.443 25.6-122.4 -58.9 145.0 42.2 0.6 12.2 52 53 A D T 4 S+ 0 0 42 -22,-3.1 3,-0.5 1,-0.2 -21,-0.1 0.856 107.4 59.2 -59.8 -36.1 39.6 -1.6 13.7 53 54 A H T 4 S+ 0 0 107 -23,-0.4 -1,-0.2 1,-0.2 -22,-0.1 0.825 117.7 28.6 -69.3 -25.5 41.4 -1.7 17.1 54 55 A S T 4 S+ 0 0 6 -3,-0.4 16,-3.1 201,-0.1 -1,-0.2 0.363 87.1 125.4-114.9 1.5 41.3 2.1 17.6 55 56 A R E < -A 69 0A 33 -4,-0.8 2,-0.5 -3,-0.5 14,-0.3 -0.263 62.2-118.8 -66.0 150.7 38.2 3.2 15.8 56 57 A I E - 0 0 8 12,-1.9 10,-0.6 10,-0.3 2,-0.5 -0.793 25.6-148.0 -86.0 127.3 35.6 5.3 17.6 57 58 A K E -A 65 0A 116 -2,-0.5 8,-0.2 8,-0.1 2,-0.1 -0.848 11.7-129.6 -94.2 126.2 32.3 3.5 17.7 58 59 A L - 0 0 4 6,-3.0 2,-1.7 -2,-0.5 39,-0.1 -0.492 26.1-118.1 -59.8 143.5 29.1 5.7 17.7 59 60 A H S S+ 0 0 128 -2,-0.1 2,-0.3 37,-0.1 -1,-0.1 -0.434 78.3 106.7 -86.4 68.5 26.7 4.5 20.5 60 61 A Q - 0 0 50 -2,-1.7 -2,-0.1 1,-0.1 4,-0.1 -0.969 65.9-140.4-143.5 154.9 24.0 3.5 18.1 61 62 A E S S+ 0 0 201 -2,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.748 92.0 67.6 -89.8 -22.7 22.6 0.2 17.0 62 63 A D S S- 0 0 134 1,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.976 127.1 -26.8 -59.4 -55.2 21.9 1.0 13.3 63 64 A N - 0 0 16 2,-0.0 -1,-0.2 -24,-0.0 -2,-0.1 -0.804 53.7-165.3-167.0 110.1 25.6 1.4 12.3 64 65 A D + 0 0 43 -2,-0.3 -6,-3.0 -3,-0.2 2,-0.4 0.339 49.4 122.9 -82.1 8.5 28.3 2.5 14.8 65 66 A Y E +A 57 0A 0 -8,-0.2 2,-0.3 -32,-0.1 -8,-0.1 -0.548 24.3 156.3 -86.4 129.6 31.0 3.3 12.1 66 67 A I E - 0 0 6 -10,-0.6 2,-2.1 -2,-0.4 -10,-0.3 -0.990 50.5-112.9-137.9 147.0 32.7 6.7 11.7 67 68 A N E S+ 0 0 0 -25,-0.5 17,-1.5 -2,-0.3 2,-0.3 -0.574 78.7 113.2 -75.8 79.5 36.1 7.4 10.1 68 69 A A E - B 0 83A 0 -2,-2.1 -12,-1.9 15,-0.2 2,-0.4 -0.984 46.9-159.0-149.1 147.1 37.7 8.4 13.4 69 70 A S E -AB 55 82A 0 13,-2.8 13,-2.6 -2,-0.3 2,-0.7 -0.982 18.1-128.9-133.2 145.4 40.4 7.0 15.6 70 71 A L E - B 0 81A 36 -16,-3.1 2,-0.7 -2,-0.4 11,-0.2 -0.812 18.7-163.0 -91.3 116.6 41.4 7.3 19.2 71 72 A I E - B 0 80A 1 9,-3.5 9,-2.1 -2,-0.7 2,-0.7 -0.869 9.3-170.7 -96.1 110.1 45.1 8.1 19.5 72 73 A K E - B 0 79A 101 -2,-0.7 2,-0.9 7,-0.2 7,-0.2 -0.896 7.8-160.8-113.7 105.2 46.0 7.3 23.2 73 74 A M E >> - B 0 78A 7 5,-2.5 5,-1.2 -2,-0.7 4,-1.1 -0.787 8.2-170.4 -91.9 107.7 49.4 8.5 24.1 74 75 A E T 45S+ 0 0 170 -2,-0.9 -1,-0.2 2,-0.2 3,-0.2 0.970 77.6 37.4 -71.3 -56.4 50.3 6.5 27.1 75 76 A E T 45S+ 0 0 98 1,-0.2 -1,-0.2 2,-0.1 -2,-0.1 0.926 121.7 46.3 -57.9 -51.7 53.5 8.0 28.6 76 77 A A T 45S- 0 0 6 2,-0.1 -1,-0.2 1,-0.0 -2,-0.2 0.697 101.7-139.7 -57.5 -25.9 52.4 11.6 27.7 77 78 A Q T <5 + 0 0 157 -4,-1.1 2,-0.4 1,-0.2 -3,-0.2 0.863 59.5 121.6 62.1 31.3 49.0 10.8 29.1 78 79 A R E < -B 73 0A 36 -5,-1.2 -5,-2.5 2,-0.0 2,-0.3 -0.998 42.3-163.6-124.0 139.1 47.0 12.7 26.4 79 80 A S E -B 72 0A 39 -2,-0.4 131,-0.7 -7,-0.2 2,-0.4 -0.906 5.8-174.2-115.2 147.2 44.4 11.2 24.0 80 81 A Y E -Bc 71 210A 0 -9,-2.1 -9,-3.5 -2,-0.3 2,-0.6 -0.995 21.1-139.5-132.1 141.4 43.1 12.7 20.7 81 82 A I E -Bc 70 211A 0 129,-3.0 131,-3.5 -2,-0.4 2,-0.4 -0.920 22.5-164.3 -92.3 123.3 40.4 11.6 18.4 82 83 A L E +Bc 69 212A 1 -13,-2.6 -13,-2.8 -2,-0.6 2,-0.3 -0.891 18.4 161.3-105.8 136.0 41.5 12.2 14.8 83 84 A T E -Bc 68 213A 2 129,-2.0 131,-0.7 -2,-0.4 -15,-0.2 -0.969 37.3-100.6-147.2 162.2 38.9 12.1 12.1 84 85 A Q - 0 0 4 -17,-1.5 132,-0.3 -2,-0.3 131,-0.2 -0.321 56.6 -78.1 -73.5 169.8 38.3 13.2 8.5 85 86 A G - 0 0 0 130,-3.1 -1,-0.1 34,-0.3 130,-0.1 -0.523 65.2 -98.6 -68.2 125.9 36.4 16.3 7.5 86 87 A P - 0 0 2 0, 0.0 35,-2.5 0, 0.0 5,-0.1 -0.145 35.3-132.6 -49.3 140.8 32.7 15.3 7.9 87 88 A L > - 0 0 18 33,-0.2 3,-1.4 -45,-0.1 4,-0.4 -0.420 31.8 -98.3 -85.0 163.4 30.9 14.3 4.8 88 89 A P T 3 S+ 0 0 118 0, 0.0 3,-0.2 0, 0.0 4,-0.1 0.797 127.2 41.9 -60.0 -19.6 27.4 15.7 3.9 89 90 A N T 3 S+ 0 0 64 -48,-0.2 4,-0.2 1,-0.1 3,-0.1 0.462 112.0 53.3-103.5 3.7 25.9 12.5 5.4 90 91 A T S <> S+ 0 0 4 -3,-1.4 4,-2.0 2,-0.1 -1,-0.1 0.128 73.7 97.1-124.3 18.9 28.2 12.1 8.4 91 92 A C H > S+ 0 0 12 -4,-0.4 4,-1.9 -3,-0.2 5,-0.1 0.863 87.4 49.9 -76.3 -35.3 27.8 15.5 10.1 92 93 A G H > S+ 0 0 3 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.915 112.0 48.9 -56.2 -47.0 25.2 14.1 12.5 93 94 A H H > S+ 0 0 12 2,-0.2 4,-2.5 -4,-0.2 -2,-0.2 0.861 108.5 54.7 -56.8 -47.3 27.6 11.1 13.2 94 95 A F H X S+ 0 0 2 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.938 112.6 41.0 -53.3 -52.2 30.5 13.6 13.9 95 96 A W H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.801 110.0 59.5 -70.7 -31.8 28.5 15.6 16.5 96 97 A E H X S+ 0 0 14 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.936 108.5 45.9 -52.7 -49.6 27.1 12.2 17.9 97 98 A M H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 6,-0.3 0.888 110.4 51.9 -64.8 -44.0 30.8 11.3 18.6 98 99 A V H X>S+ 0 0 0 -4,-2.0 5,-1.6 2,-0.2 4,-0.7 0.947 115.0 43.8 -54.9 -48.9 31.6 14.7 20.1 99 100 A W H ><5S+ 0 0 27 -4,-2.6 3,-0.7 2,-0.2 -2,-0.2 0.957 118.1 42.6 -55.9 -56.3 28.6 14.3 22.4 100 101 A E H 3<5S+ 0 0 42 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.872 115.1 49.2 -65.0 -39.0 29.3 10.6 23.3 101 102 A Q H 3<5S- 0 0 45 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.567 105.1-131.2 -76.2 -10.0 33.1 11.1 23.7 102 103 A K T <<5 + 0 0 132 -4,-0.7 106,-3.1 -3,-0.7 -3,-0.2 0.783 41.6 174.5 62.6 33.2 32.5 14.2 26.0 103 104 A S B < -i 208 0B 3 -5,-1.6 -1,-0.2 -6,-0.3 107,-0.1 -0.405 26.6-164.9 -72.9 146.4 34.9 16.3 24.0 104 105 A R + 0 0 47 104,-0.5 67,-2.8 98,-0.4 2,-0.3 0.723 69.4 39.7 -96.5 -32.1 35.2 19.9 24.9 105 106 A G E -d 171 0A 0 97,-0.5 106,-2.3 65,-0.2 2,-0.4 -0.898 54.7-159.4-126.1 151.5 37.1 21.1 21.8 106 107 A V E -de 172 211A 0 65,-2.5 67,-3.0 -2,-0.3 2,-0.6 -0.998 11.8-159.3-122.2 122.4 37.2 20.6 18.1 107 108 A V E -de 173 212A 0 104,-3.4 106,-2.9 -2,-0.4 2,-0.5 -0.926 8.2-172.4-103.7 116.7 40.4 21.5 16.2 108 109 A M E +de 174 213A 0 65,-2.3 67,-2.3 -2,-0.6 106,-0.2 -0.940 9.1 177.8-111.2 116.8 39.8 22.0 12.5 109 110 A L + 0 0 0 104,-2.9 2,-0.2 -2,-0.5 69,-0.2 0.374 58.8 61.0-108.3 6.6 43.0 22.5 10.5 110 111 A N S S- 0 0 0 103,-0.3 2,-0.3 104,-0.1 67,-0.1 -0.754 74.7-119.1-120.2 165.4 41.5 22.8 7.0 111 112 A R - 0 0 118 -2,-0.2 8,-0.3 67,-0.2 3,-0.1 -0.719 27.4-118.0 -93.9 160.0 39.2 25.1 5.1 112 113 A V S S+ 0 0 35 -2,-0.3 7,-2.8 1,-0.2 8,-0.9 0.919 107.5 40.0 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-18.0 60.2 14.9 32.2 238 239 A K T <5 + 0 0 108 -4,-1.9 -3,-0.2 -5,-0.2 -4,-0.1 0.801 67.9 117.2 48.9 37.9 61.8 18.3 31.8 239 240 A D > < + 0 0 75 -5,-0.5 3,-1.1 -6,-0.3 4,-0.2 -0.820 39.9 177.9-135.0 88.6 64.3 16.5 29.6 240 241 A P G > S+ 0 0 23 0, 0.0 3,-1.8 0, 0.0 -238,-0.2 0.883 82.4 58.9 -59.0 -36.3 64.3 17.6 25.8 241 242 A S G 3 S+ 0 0 76 1,-0.3 -7,-0.0 -240,-0.1 -2,-0.0 0.685 96.3 64.1 -65.3 -20.0 67.1 15.3 24.9 242 243 A S G < S+ 0 0 41 -3,-1.1 2,-0.6 -8,-0.1 -1,-0.3 0.552 83.1 93.7 -79.7 -8.6 65.0 12.4 26.0 243 244 A V < - 0 0 7 -3,-1.8 2,-0.8 -4,-0.2 -241,-0.2 -0.776 54.6-167.0 -97.1 125.3 62.3 13.0 23.4 244 245 A D > - 0 0 54 -2,-0.6 4,-2.3 1,-0.2 5,-0.2 -0.889 2.0-168.3-108.3 96.5 62.6 11.1 20.1 245 246 A I H > S+ 0 0 1 -2,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.871 85.2 50.5 -53.8 -45.4 60.2 12.8 17.7 246 247 A K H > S+ 0 0 63 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.910 111.8 48.8 -61.2 -46.1 60.4 10.0 15.0 247 248 A K H > S+ 0 0 144 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.884 109.6 51.4 -59.6 -40.6 59.7 7.4 17.6 248 249 A V H X S+ 0 0 14 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.896 109.6 51.4 -66.5 -36.4 56.7 9.4 19.0 249 250 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.911 108.1 50.7 -64.2 -41.3 55.3 9.6 15.5 250 251 A L H < S+ 0 0 38 -4,-2.3 4,-0.5 2,-0.2 -223,-0.3 0.896 109.6 52.5 -63.4 -36.6 55.6 5.8 15.0 251 252 A D H >< S+ 0 0 54 -4,-2.0 3,-1.0 1,-0.2 4,-0.3 0.926 109.7 46.9 -62.9 -42.9 53.8 5.4 18.3 252 253 A M H >X S+ 0 0 1 -4,-2.5 3,-2.0 1,-0.2 4,-0.9 0.880 103.4 63.1 -62.0 -38.3 51.0 7.6 17.1 253 254 A R T 3< S+ 0 0 11 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.610 87.4 73.1 -63.1 -16.9 50.9 5.8 13.8 254 255 A K T <4 S+ 0 0 94 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.743 103.8 41.1 -61.9 -20.7 49.9 2.6 15.8 255 256 A F T <4 S+ 0 0 30 -3,-2.0 -204,-0.4 1,-0.3 2,-0.3 0.671 129.4 9.2-106.4 -21.7 46.5 4.3 16.3 256 257 A R S >< S- 0 0 0 -4,-0.9 3,-0.7 -206,-0.1 -1,-0.3 -0.958 77.6-115.2-155.7 141.3 45.8 5.8 12.8 257 258 A M T 3 S+ 0 0 49 -208,-0.6 -3,-0.1 -2,-0.3 -229,-0.1 -0.358 85.4 18.2 -67.7 156.9 47.6 5.4 9.5 258 259 A G T 3 + 0 0 12 1,-0.2 2,-0.2 -235,-0.1 -1,-0.2 0.587 69.1 175.5 77.3 6.0 49.4 8.1 7.5 259 260 A L < + 0 0 0 -3,-0.7 -40,-0.2 -10,-0.1 -1,-0.2 -0.388 67.6 19.2 -60.5 125.3 49.9 10.7 10.3 260 261 A I S S- 0 0 0 -42,-2.0 -41,-0.2 -2,-0.2 -40,-0.1 0.754 76.2-155.8 69.6 110.2 52.0 13.5 8.8 261 262 A Q + 0 0 47 -79,-0.1 2,-0.3 1,-0.0 -42,-0.1 0.517 64.2 40.2 -97.1 -10.8 51.7 13.2 5.0 262 263 A T S > S- 0 0 31 -43,-0.1 4,-1.4 -80,-0.1 3,-0.2 -0.956 74.7-120.8-138.6 157.2 54.9 14.9 3.8 263 264 A A H > S+ 0 0 19 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.781 114.1 56.1 -65.4 -31.1 58.5 15.1 4.7 264 265 A D H > S+ 0 0 82 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.774 101.9 54.8 -72.1 -30.0 58.3 18.9 5.1 265 266 A Q H > S+ 0 0 0 2,-0.2 4,-1.9 -3,-0.2 -2,-0.2 0.865 110.5 48.1 -66.0 -32.9 55.4 18.5 7.7 266 267 A L H X S+ 0 0 0 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.935 111.5 48.3 -67.4 -49.9 57.9 16.3 9.6 267 268 A R H X S+ 0 0 66 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.929 112.2 50.7 -50.9 -48.3 60.6 18.9 9.2 268 269 A F H X S+ 0 0 11 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.853 103.7 58.4 -57.9 -39.6 58.1 21.5 10.4 269 270 A S H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.910 105.1 50.5 -54.5 -47.0 57.2 19.3 13.4 270 271 A Y H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.882 110.4 48.7 -57.5 -46.3 60.9 19.4 14.5 271 272 A L H X S+ 0 0 45 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.863 111.7 49.7 -60.5 -44.0 61.0 23.2 14.2 272 273 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.885 115.1 43.0 -62.9 -44.7 57.8 23.5 16.2 273 274 A V H X S+ 0 0 0 -4,-2.5 4,-1.4 2,-0.2 -2,-0.2 0.863 113.9 50.9 -70.4 -39.1 59.0 21.2 19.0 274 275 A I H < S+ 0 0 25 -4,-2.7 4,-0.4 -5,-0.2 -2,-0.2 0.930 117.0 40.2 -63.5 -46.6 62.5 22.8 19.0 275 276 A E H >X S+ 0 0 44 -4,-2.5 3,-1.3 1,-0.2 4,-0.6 0.905 113.3 54.2 -63.1 -43.8 60.9 26.3 19.3 276 277 A G H 3X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.3 3,-0.5 0.777 94.0 71.8 -61.8 -26.9 58.2 25.1 21.7 277 278 A A H 3X S+ 0 0 14 -4,-1.4 4,-2.5 1,-0.2 -1,-0.3 0.757 86.7 64.6 -59.8 -33.1 60.9 23.7 24.0 278 279 A K H <4>S+ 0 0 100 -3,-1.3 5,-2.5 -4,-0.4 -1,-0.2 0.923 108.9 39.3 -53.8 -48.6 62.0 27.2 25.0 279 280 A F H ><5S+ 0 0 36 -4,-0.6 3,-2.0 -3,-0.5 -2,-0.2 0.942 115.6 50.2 -64.0 -57.8 58.6 27.8 26.6 280 281 A I H 3<5S+ 0 0 4 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.868 106.5 57.5 -50.6 -34.8 58.4 24.2 28.1 281 282 A M T 3<5S- 0 0 85 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.331 132.7 -86.6 -91.2 18.2 61.9 24.6 29.6 282 283 A G T < 5S+ 0 0 60 -3,-2.0 2,-1.3 1,-0.2 -3,-0.2 0.551 87.6 127.4 99.8 17.6 60.7 27.7 31.4 283 284 A D > < + 0 0 75 -5,-2.5 3,-1.4 -6,-0.2 4,-0.4 -0.721 29.3 175.3 -93.3 82.2 61.1 30.8 29.3 284 285 A S T > + 0 0 86 -2,-1.3 3,-1.4 1,-0.2 4,-0.5 0.832 66.9 71.3 -54.5 -35.4 57.5 31.8 29.8 285 286 A S T >> S+ 0 0 64 1,-0.2 4,-1.4 -3,-0.2 3,-0.5 0.749 79.3 73.2 -57.0 -21.3 58.1 35.1 27.8 286 287 A V H <> S+ 0 0 4 -3,-1.4 4,-2.8 1,-0.2 -1,-0.2 0.797 85.5 68.4 -65.7 -28.0 58.4 33.3 24.4 287 288 A Q H <> S+ 0 0 43 -3,-1.4 4,-2.4 -4,-0.4 -1,-0.2 0.924 102.0 43.8 -51.0 -50.9 54.6 32.8 24.4 288 289 A D H <> S+ 0 0 111 -3,-0.5 4,-2.0 -4,-0.5 -1,-0.2 0.844 111.1 55.9 -69.9 -29.4 53.9 36.4 24.1 289 290 A Q H X S+ 0 0 99 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.922 107.5 49.5 -56.0 -50.6 56.7 36.6 21.4 290 291 A W H X S+ 0 0 1 -4,-2.8 4,-1.7 1,-0.2 -2,-0.2 0.916 109.2 51.7 -51.5 -53.0 54.9 33.9 19.5 291 292 A K H <>S+ 0 0 88 -4,-2.4 5,-0.7 2,-0.2 4,-0.4 0.847 111.9 45.8 -54.6 -38.6 51.7 35.9 19.8 292 293 A E H ><5S+ 0 0 157 -4,-2.0 3,-1.1 1,-0.2 -2,-0.2 0.930 113.8 48.7 -71.1 -46.3 53.4 39.1 18.4 293 294 A L H 3<5S+ 0 0 101 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.761 103.5 62.1 -55.0 -35.0 55.1 37.3 15.5 294 295 A S T 3<5S- 0 0 9 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.631 91.6-145.7 -76.9 -10.5 51.9 35.5 14.5 295 296 A H T < 5 + 0 0 139 -3,-1.1 -3,-0.1 -4,-0.4 -2,-0.1 0.888 32.3 166.8 48.8 50.3 50.1 38.9 13.7 296 297 A E < 0 0 5 -5,-0.7 -146,-2.2 -146,-0.1 -144,-0.2 0.638 360.0 360.0 -75.6 -15.3 46.7 37.5 14.9 297 298 A D 0 0 174 -148,-0.2 -148,-0.1 -147,-0.1 0, 0.0 -0.667 360.0 360.0 -89.0 360.0 44.8 40.8 15.1